2,4(1H,3H)-Pyrimidinedione, 5-methyl-1,3-bis((pentafluorophenyl)methyl)-
Basic information
- CAS
99268-59-4- Standard SMILES
Cc1cn(Cc2c(F)c(F)c(F)c(F)c2F)c(=O)n(Cc2c(F)c(F)c(F)c(F)c2F)c1=O- InChIKey
ASCFJMQYYJENMR-UHFFFAOYSA-N- Molecular formula
- C19H8F10N2O2
- Average molar mass
- 486.3 g/mol
- Monoisotopic mass
- 486.04260912
Names & identifiers
- Preferred name
- 2,4(1H,3H)-Pyrimidinedione, 5-methyl-1,3-bis((pentafluorophenyl)methyl)-
- IUPAC
- 5-methyl-1,3-bis[(2,3,4,5,6-pentafluorophenyl)methyl]pyrimidine-2,4-dione
Names & synonyms
2,4(1H,3H)-Pyrimidinedione, 5-methyl-1,3-bis((pentafluorophenyl)methyl)-99268-59-4DTXSID102440145-Methyl-1,3-bis[(pentafluorophenyl)methyl]pyrimidine-2,4(1H,3H)-dione
Database identifiers
- CAS
99268-59-4- PubChem CID
- 180741
- DTXSID
DTXSID10244014- Nikkaji
- J810.725D
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 40.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 4
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 771
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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